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#10;PERGULARIN-3-O-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMA
SpectraBase Compound ID HbciXMQbKVd
InChI InChI=1S/C56H92O20/c1-27-48(59)37(62-9)22-44(67-27)73-50-29(3)69-46(24-39(50)64-11)75-52-31(5)71-47(26-41(52)66-13)76-51-30(4)70-45(25-40(51)65-12)74-49-28(2)68-43(23-38(49)63-10)72-34-16-17-53(7)33(20-34)14-15-35-36(53)21-42(58)54(8)55(60,32(6)57)18-19-56(35,54)61/h14,27-31,34-52,58-61H,15-26H2,1-13H3/t27-,28+,29-,30-,31-,34-,35+,36-,37+,38-,39+,40+,41+,42+,43-,44-,45+,46+,47-,48-,49+,50-,51-,52-,53-,54+,55+,56-/m0/s1
InChIKey QXCWUISUSYJHTC-JYZHETSFSA-N
Mol Weight 1085.3 g/mol
Molecular Formula C56H92O20
Exact Mass 1084.618195 g/mol
Enantiomer InChIKey QXCWUISUSYJHTC-NKJDWODWSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Steroidal Glycosides from the Root of Metaplexis japonica M. Part II. Chemical and Pharmaceutical Bulletin 1998

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